N-(4-Aminobenzoyl)-L-glutamic acid 分子结构式
HCID196473

N-(4-Aminobenzoyl)-L-glutamic acid

(2S)-2-[(4-aminobenzoyl)amino]pentanedioic acid

C12H14N2O5266.25 g/molCAS 4271-30-1

IDENTITY

结构与身份

标准SMILES
Nc1ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc1
InChIKey
GADGMZDHLQLZRI-VIFPVBQESA-N
分子式
C12H14N2O5
平均分子量
266.25 g/mol
单同位素质量
266.09027155

COMPUTED

结构计算性质

已同步
XLogP
0
极性表面积
130 Ų
氢键供体
4
氢键受体
6
可旋转键
6
重原子
19
形式电荷
0
复杂度
350

GHS

GHS分类

来源:PubChem
GHS Classification

Danger

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral];H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (33.3%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H334 (33.3%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory];H335 (33.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

HAZARDS

危害信息

来源:PubChem
Regulatory Information

N-(4-Aminobenzoyl)-L-glutamic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and Categories

Skin Sens. 1 (33.3%);Resp. Sens. 1 (33.3%)

REGULATORY

法规信息

来源:PubChem
Regulatory Information

N-(4-Aminobenzoyl)-L-glutamic acid: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

ALIASES

名称与别名

共 78 条
N-(4-Aminobenzoyl)-L-glutamic acid4271-30-1N-(p-Aminobenzoyl)glutamic acidp-Aminobenzoyl-L-glutamic acidp-Aminobenzoylglutamic acid4-Aminobenzoylglutamic acidL-N-(p-Aminobenzoyl)glutamic acidL-Glutamic acid, N-(4-aminobenzoyl)-9BKY99A8HJCHEBI:61114DTXSID10873641NSC-71042PABGARefChem:162076glutamyl-p-aminobenzoic acidpara-aminobenzoylglutamic acidDTXCID80149845224-261-7(S)-2-(4-Aminobenzamido)pentanedioic acidMFCD00042821

REACTIONS

参与反应

1
HRID 1739630 反应方程式

uspto-grants-1999_10 · 10.6084/m9.figshare.5104873.v1 · US05968788

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